SCHEMBL925002

SCHEMBL925002

NC(=O)c1cccc(-c2cc(Nc3ccc(OC(F)(F)F)cc3)ncn2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 19/20 1.00
BCR P11274 18/20 1.00
KDM4E B2RXH2 1/20 1.00
MAPT P10636 1/20 1.00
MAPK1 P28482 1/20 1.00
KIT P10721 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29936260 1.00 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL29438984 1.00 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL25735737 0.92 ABL1 (0.85) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL924853 0.90 ABL1 (0.82) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL10013582 0.89 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL3399317 0.89 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL12942835 0.88 ABL1 (0.88) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL13771172 0.88 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL25639124 0.86 ABL1 (0.82) ABL1BCRKDM4EMAPTMAPK1
SCHEMBL3900043 0.84 ABL1 (1.00) ABL1BCRKDM4EMAPTMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12133720-B2 Methods and compositions for restoring homeostatic capacity of a subject Palo Alto Investors LP (US) 2024-11-05 US disclosed
EP-4313007-A1 TRANSDERMAL SYSTEM, FORMULATION, AND METHOD FOR THE THERAPEUTIC ADMINISTRATION OF A PSYCHEDELIC AGENT Lyfe CHNG, LLC (US) 2024-02-07 EP disclosed
US-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. 2024-01-25 US disclosed
EP-3700516-B1 INHIBITORS OF DUX4 INDUCTION FOR REGULATION OF MUSCLE FUNCTION SONIC MASTER LTD (VG) 2024-01-24 EP disclosed
US-20230303501-A1 C-ABL TYROSINE KINASE INHIBITORY COMPOUND EMBODIMENTS AND METHODS OF MAKING AND USING THE SAME THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2023-09-28 US disclosed
WO-2023114759-A2 ABL INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-22 WO disclosed
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. 2023-06-22 US disclosed
US-11649218-B2 C-Abl tyrosine kinase inhibitory compound embodiments and methods of making and using the same THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-05-16 US disclosed
US-20230026731-A1 TRANSDERMAL SYSTEM, FORMULATION, AND METHOD FOR THE THERAPEUTIC ADMINISTRATION OF A PSYCHEDELIC AGENT LCT TECHNOLOGIES LLC 2023-01-26 US disclosed
US-20230014124-A1 HETEROCYCLIC DEGRONIMERS FOR TARGET PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2023-01-19 US disclosed
EP-2229217-A1 COMPOSITIONS AND METHODS FOR TREATING CANCERS IRM LLC (BM) 2010-09-22 EP disclosed
US-20100216828-A1 METHODS AND COMPOSITIONS FOR TREATING CANCERS IRM LLC (BM) 2010-08-26 US disclosed
EP-2187967-A1 METHODS AND COMPOSITIONS FOR TREATING CANCERS IRM LLC (BM) 2010-05-26 EP disclosed
WO-2009091476-A1 COMPOSITIONS AND METHODS FOR TREATING CANCERS IRM LLC (BM) 2009-07-23 WO disclosed
WO-2009091476-A1 COMPOSITIONS AND METHODS FOR TREATING CANCERS IRM LLC (BM) 2009-07-23 WO disclosed
EP-1613595-A4 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-01 EP disclosed
WO-2009026075-A1 METHODS AND COMPOSITIONS FOR TREATING CANCERS IRM LLC (BM) 2009-02-26 WO disclosed
EP-1613595-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-01-11 EP disclosed
US-20050014753-A1 Novel compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2005-01-20 US disclosed
WO-2004089286-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2004-10-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230026731-A1 TRANSDERMAL SYSTEM, FORMULATION, AND METHOD FOR THE THERAPEUTIC ADMINISTRATION OF A PSYCHEDELIC AGENT HTR7, HTR6, PNMT ABL1 2050/4885BCR 2791/4885KDM4E 1479/4885
US-20230014124-A1 HETEROCYCLIC DEGRONIMERS FOR TARGET PROTEIN DEGRADATION CRBN, MDM2, STUB1 ABL1 1463/4885BCR 904/4885KDM4E 1037/4885
US-20230303501-A1 C-ABL TYROSINE KINASE INHIBITORY COMPOUND EMBODIMENTS AND METHODS OF MAKING AND USING THE SAME ABL1, ABL2, MUSK ABL1 1/4885BCR 4/4885KDM4E 395/4885
US-11649218-B2 C-Abl tyrosine kinase inhibitory compound embodiments and methods of making and using the same ABL1, ABL2, MUSK ABL1 1/4885BCR 4/4885KDM4E 395/4885
US-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES COASY, JMJD7, PTMS ABL1 1917/4885BCR 1873/4885KDM4E 2788/4885
US-20050014753-A1 Novel compounds and compositions as protein kinase inhibitors ABL1, BCR, PDGFRA ABL1 1/4885BCR 2/4885KDM4E 1310/4885
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF ERBB2, ACP1, TK1 ABL1 31/4885BCR 80/4885KDM4E 2301/4885
US-20100216828-A1 METHODS AND COMPOSITIONS FOR TREATING CANCERS ABL1, KIT, SRC ABL1 1/4885BCR 4/4885KDM4E 836/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.